2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-(6-chloranyl-2-phenyl-pyrimidin-4-yl)ethanamide

Systemtic Name: 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-(6-chloranyl-2-phenyl-pyrimidin-4-yl)ethanamide Openeye Name: 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-(6-chloro-2-phenyl-pyrimidin-4-yl)acetamide CAS Name: 2-[4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]-N-(6-chloro-2-phenyl-4-pyrimidinyl)acetamide IUPAC Name: 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-N-(6-chloro-2-phenylpyrimidin-4-yl)acetamide Traditional Name: 2-[4-(4-tert-butylbenzyl)piperazino]-N-(6-chloro-2-phenyl-pyrimidin-4-yl)acetamide Formula: C27H32ClN5O MolecularWeight: 478.02888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C27H32ClN5O/c1-27(2,3)22-11-9-20(10-12-22)18-32-13-15-33(16-14-32)19-25(34)30-24-17-23(28)29-26(31-24)21-7-5-4-6-8-21/h4-12,17H,13-16,18-19H2,1-3H3,(H,29,30,31,34)